# generated using pymatgen
data_Ba7Ca2Mn3Cr2O20
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   17.69235391
_cell_length_b   17.69235400
_cell_length_c   17.69235444
_cell_angle_alpha   19.18979886
_cell_angle_beta   19.18979991
_cell_angle_gamma   19.18979895
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba7Ca2Mn3Cr2O20
_chemical_formula_sum   'Ba7 Ca2 Mn3 Cr2 O20'
_cell_volume   523.02555791
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Ba  Ba0  1  0.61186700  0.61186700  0.61186700  1.0
  Ba  Ba1  1  0.14593900  0.14593900  0.14593900  1.0
  Ba  Ba2  1  0.38813300  0.38813300  0.38813300  1.0
  Ba  Ba3  1  0.22634900  0.22634900  0.22634900  1.0
  Ba  Ba4  1  0.77365100  0.77365100  0.77365100  1.0
  Ba  Ba5  1  0.85406100  0.85406100  0.85406100  1.0
  Ba  Ba6  1  0.00000000  0.00000000  0.00000000  1.0
  Ca  Ca7  1  0.92535200  0.92535200  0.92535200  1.0
  Ca  Ca8  1  0.07464800  0.07464800  0.07464800  1.0
  Mn  Mn9  1  0.54945100  0.54945100  0.54945100  1.0
  Mn  Mn10  1  0.45054900  0.45054900  0.45054900  1.0
  Mn  Mn11  1  0.50000000  0.50000000  0.50000000  1.0
  Cr  Cr12  1  0.69730700  0.69730700  0.69730700  1.0
  Cr  Cr13  1  0.30269300  0.30269300  0.30269300  1.0
  O  O14  1  0.27813900  0.27813900  0.73637700  1.0
  O  O15  1  0.81541500  0.37727900  0.37727900  1.0
  O  O16  1  0.86758200  0.39184900  0.86758200  1.0
  O  O17  1  0.66496200  0.66496200  0.66496200  1.0
  O  O18  1  0.33503800  0.33503800  0.33503800  1.0
  O  O19  1  0.37727900  0.81541500  0.37727900  1.0
  O  O20  1  0.13241800  0.13241800  0.60815100  1.0
  O  O21  1  0.86758200  0.86758200  0.39184900  1.0
  O  O22  1  0.72186100  0.26362300  0.72186100  1.0
  O  O23  1  0.26362300  0.72186100  0.72186100  1.0
  O  O24  1  0.27813900  0.73637700  0.27813900  1.0
  O  O25  1  0.39184900  0.86758200  0.86758200  1.0
  O  O26  1  0.72186100  0.72186100  0.26362300  1.0
  O  O27  1  0.62272100  0.18458500  0.62272100  1.0
  O  O28  1  0.18458500  0.62272100  0.62272100  1.0
  O  O29  1  0.13241800  0.60815100  0.13241800  1.0
  O  O30  1  0.60815100  0.13241800  0.13241800  1.0
  O  O31  1  0.62272100  0.62272100  0.18458500  1.0
  O  O32  1  0.37727900  0.37727900  0.81541500  1.0
  O  O33  1  0.73637700  0.27813900  0.27813900  1.0